N-(1-acetylpiperidin-4-yl)-N'-(3,4-dimethylphenyl)-N-{3-[(propan-2-yl)oxy]propyl}thiourea
Chemical Structure Depiction of
N-(1-acetylpiperidin-4-yl)-N'-(3,4-dimethylphenyl)-N-{3-[(propan-2-yl)oxy]propyl}thiourea
N-(1-acetylpiperidin-4-yl)-N'-(3,4-dimethylphenyl)-N-{3-[(propan-2-yl)oxy]propyl}thiourea
Compound characteristics
Compound ID: | K786-4081 |
Compound Name: | N-(1-acetylpiperidin-4-yl)-N'-(3,4-dimethylphenyl)-N-{3-[(propan-2-yl)oxy]propyl}thiourea |
Molecular Weight: | 405.6 |
Molecular Formula: | C22 H35 N3 O2 S |
Smiles: | CC(C)OCCCN(C1CCN(CC1)C(C)=O)C(Nc1ccc(C)c(C)c1)=S |
Stereo: | ACHIRAL |
logP: | 4.241 |
logD: | 4.241 |
logSw: | -4.1485 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 34.319 |
InChI Key: | YGYQSPTYDHQJLV-UHFFFAOYSA-N |